canSAR1632069
FEATURES
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NAMES
    SMILES
    O=C1C=C(NCc2ccco2)C2(CCCCC2)O1
    InChI
    InChI=1S/C14H17NO3/c16-13-9-12(15-10-11-5-4-8-17-11)14(18-13)6-2-1-3-7-14/h4-5,8-9,15H,1-3,6-7,10H2
    MOLECULAR FORMULA
    C14H17NO3
    CROSS REFERENCES
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    canSAR1632069
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight247.12
    AlogP2.51
    HBond donors1
    HBond acceptors4
    Atoms35
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632069.